2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-keto-2-mesityl-ethyl)thio]-6-propyl-1H-pyrimidin-4-one Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C18H22N2O2S/c1-5-6-14-9-16(22)20-18(19-14)23-10-15(21)17-12(3)7-11(2)8-13(17)4/h7-9H,5-6,10H2,1-4H3,(H,19,20,22)